2-[[5,6-dimethyl-7-(4-methylpyridin-2-yl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5,6-dimethyl-7-(4-methylpyridin-2-yl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[5,6-dimethyl-7-(4-methyl-2-pyridyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[5,6-dimethyl-7-(4-methyl-2-pyridinyl)-4-pyrrolo[2,3-d]pyrimidinyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5,6-dimethyl-7-(4-methylpyridin-2-yl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[5,6-dimethyl-7-(4-methyl-2-pyridyl)pyrrolo[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-ammonium Formula: C18H25N6+ MolecularWeight: 325.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=C(C3=C2N=CN=C3NCC[NH+](C)C)C)C

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=C(C3=C2N=CN=C3NCC[NH+](C)C)C)C

InChI

InChI=1S/C18H24N6/c1-12-6-7-19-15(10-12)24-14(3)13(2)16-17(20-8-9-23(4)5)21-11-22-18(16)24/h6-7,10-11H,8-9H2,1-5H3,(H,20,21,22)/p+1